2-[2-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[2-[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]acetamide CAS Name: 2-[2-[[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]thio]-1-benzimidazolyl]-N-propan-2-ylacetamide IUPAC Name: 2-[2-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]sulfanylbenzimidazol-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[2-[[2-keto-2-[(3S)-3-methylpiperidino]ethyl]thio]benzimidazol-1-yl]acetamide Formula: C20H28N4O2S MolecularWeight: 388.52692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NC(C)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3N2CC(=O)NC(C)C

InChI

InChI=1S/C20H28N4O2S/c1-14(2)21-18(25)12-24-17-9-5-4-8-16(17)22-20(24)27-13-19(26)23-10-6-7-15(3)11-23/h4-5,8-9,14-15H,6-7,10-13H2,1-3H3,(H,21,25)/t15-/m0/s1